AG005ERA

7785-70-8 | (1R,5R)-2,6,6-Trimethylbicyclo[3.1.1]hept-2-ene

AG005ERA

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CAS Number	7785-70-8
Catalog Number	AG005ERA(AGN-PC-0OI2KD)
Chemical Name	(1R,5R)-2,6,6-Trimethylbicyclo[3.1.1]hept-2-ene
EC Number	232-087-8
IUPAC Name	(1R,5R)-2,6,6-trimethylbicyclo[3.1.1]hept-2-ene
InChI	InChI=1S/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h4,8-9H,5-6H2,1-3H3/t8-,9-/m1/s1
InChI Key	GRWFGVWFFZKLTI-RKDXNWHRSA-N
MDL Number	MFCD17015806
Molecular Formula	C10H16
Molecular Weight	136.2340
SMILES	CC=1[C@@H]2C([C@H](CC1)C2)(C)C
UNII	H6CM4TWH1W
Synonyms	7785-70-8, (+)-alpha-Pinene, (1R,5R)-2,6,6-Trimethylbicyclo[3.1.1]hept-2-ene, (1R)-(+)-alpha-Pinene, (1R,5R)-alpha-pinene, UNII-H6CM4TWH1W, (+)--Pinene, MFCD00001346, H6CM4TWH1W, (1R,5R)-2-Pinene, CHEBI:28261, (+)-3,6,6-TRIMETHYLBICYCLO[3.1.1]HEPT-2-ENE, Bicyclo[3.1.1]hept-2-ene, 2,6,6-trimethyl-, (1R,5R)-, (+)-Pin-2(3)-ene, (1R,5R)-4,6,6-trimethylbicyclo[3.1.1]hept-3-ene, Bicyclo(3.1.1)hept-2-ene, 2,6,6-trimethyl-, (1R,5R)-, alpha-Pinene(dextro), 1R-(+)-a-pinene, (1R)-(+)-alpha-Pinene, 98%, 80% ee, (1S)-(-)-alpha-Pinene, alpha-Pinene, (+)-, CCRIS 9059, l-Pinen, D-alpha-PINENE, EINECS 232-087-8, alpha-Pinene, 98%, PubChem18155, (+)-.alpha.-Pinene, (1S,5S)-4,7,7-trimethylbicyclo[3.1.1]hept-3-ene, EC 232-087-8, (1R,5R)-pin-2-ene, DSSTox_CID_21671, DSSTox_RID_79811, DSSTox_GSID_41671, (+)-alpha-Pinene, 98%, KSC918A0J, (1R)-(+)-|A-Pinene, CHEMBL1236329, DTXSID7041671, (+)-alpha-Pinene, >=99%, CTK8B8004, (+)-(1R,5R)-|A-pinene, GRWFGVWFFZKLTI-RKDXNWHRSA-N, ZINC967579, Tox21_303429, 2203AC, ANW-59110, (+)-alpha-Pinene, analytical standard, EBD2198276, LMPR0102120012, NE10091, RP20300, RTR-024907, ( inverted exclamation markA)-2-Pinene, NCGC00257486-01, (1R)-(+)-alpha-Pinene, 97%, FG, AJ-24533, AS-35304, BC000911, SC-23004, CAS-7785-70-8, ST2414095, 4,7,7-trimethylbicyclo[3.1.1]hept-3-ene, C06306, 785P264, A839247, I14-7863, Q-101284, alpha-Pinene, primary pharmaceutical reference standard, UNII-JPF3YI7O34 component GRWFGVWFFZKLTI-RKDXNWHRSA-N, Bicyclo(3.1.1)hept-2-ene, 2,6,6-trimethyl-, (1theta)-, .alpha.-Pinene, |A-pinene, d-.alpha.-Pinene, ALPHA-PINENE, (+)-|A-Pinene, Phosphosulfurized alpha-pinene, C10H16, CID82227, 2-Pinene, (1R,5R)-()-, C10-H16, CB10228, (+) - pin - 2(3) - ene, 2,6,6-Trimethylbicyclo[3.1.1]hept-2-ene, (1R)-( )-alpha-Pinene, 98% - 100G 100g, (1R)-2,6,6-Trimethylbicyclo[3.1.1]hept-2-ene, Bicyclo(3.1.1)hept-2-ene, 2,6,6-trimethyl-, (1R)-, Bicyclo[3.1.1]hept-2-ene, 2,6,6-trimethyl-, (1R)-, TMH, 7785-26-4, 80-56-8,

Complexity	186
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	136.125g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	136.238g/mol
Monoisotopic Mass	136.125g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	0A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	3
Hazard statements	H317-H401-H411-H226-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P305+P351+P338-P210-P280a-P303+P361+P353-P501a
UN Code	UN 2368

Certificate of Analysis

Lot Number